4-(3-methylsulfanyl-4-phenyl-1H-1,2,4-triazol-5-ylidene)cyclohexa-2,5-dien-1-one

Systemtic Name: 4-(3-methylsulfanyl-4-phenyl-1H-1,2,4-triazol-5-ylidene)cyclohexa-2,5-dien-1-one Openeye Name: 4-(3-methylsulfanyl-4-phenyl-1H-1,2,4-triazol-5-ylidene)cyclohexa-2,5-dien-1-one CAS Name: 4-[3-(methylthio)-4-phenyl-1H-1,2,4-triazol-5-ylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-(3-methylsulfanyl-4-phenyl-1H-1,2,4-triazol-5-ylidene)cyclohexa-2,5-dien-1-one Traditional Name: 4-[3-(methylthio)-4-phenyl-1H-1,2,4-triazol-5-ylidene]cyclohexa-2,5-dien-1-one Formula: C15H13N3OS MolecularWeight: 283.34822

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=NNC(=C2C=CC(=O)C=C2)N1C3=CC=CC=C3

Isomeric SMILES

CSC1=NNC(=C2C=CC(=O)C=C2)N1C3=CC=CC=C3

InChI

InChI=1S/C15H13N3OS/c1-20-15-17-16-14(11-7-9-13(19)10-8-11)18(15)12-5-3-2-4-6-12/h2-10,16H,1H3